3-(azepan-1-yl)propyl 2-(4-chloranylphenoxy)ethanoate

Systemtic Name: 3-(azepan-1-yl)propyl 2-(4-chloranylphenoxy)ethanoate Openeye Name: 3-(azepan-1-yl)propyl 2-(4-chlorophenoxy)acetate CAS Name: 2-(4-chlorophenoxy)acetic acid 3-(1-azepanyl)propyl ester IUPAC Name: 3-(azepan-1-yl)propyl 2-(4-chlorophenoxy)acetate Traditional Name: 2-(4-chlorophenoxy)acetic acid 3-(azepan-1-yl)propyl ester Formula: C17H24ClNO3 MolecularWeight: 325.83036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCOC(=O)COC2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCCN(CC1)CCCOC(=O)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H24ClNO3/c18-15-6-8-16(9-7-15)22-14-17(20)21-13-5-12-19-10-3-1-2-4-11-19/h6-9H,1-5,10-14H2